Geometry & MOs

Info

ID:	386862
PubChem CID:	134983178
Reduced:	OC7H7 (2)
Stoich.:	AB7C7 (2)
Weight, g/mol:	109.101725
ΔH_f, kcal/mol:	-34.6
Dipole, Da:	5.06
IP(EA), eV:	-9.56(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC(=O)/C=C\C=C\C1=CC=C(C=C1)C(=O)C

DOS

IR

Vibrations